N-(2-丙基戊基)-4-(三氟甲基)苯甲酰胺
TL;DR: N-(2-丙基戊基)-4-(三氟甲基)苯甲酰胺 (CAS 53478-57-2) is a chemical compound with molecular formula C16H22F3NO and molecular weight 301.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-丙基戊基)-4-(三氟甲基)苯甲酰胺
N-(2-propylpentyl)-4-(trifluoromethyl)benzamide
Also Known As: N-(2-Propylpentyl)-4-(trifluoromethyl)benzamide, Benzamide, N-(2-propylpentyl)-4-(trifluoromethyl)-, Benzamide,N-(2-propylpentyl)-4-(trifluoromethyl), BRN 2287940, RefChem:322262
| Molecular Formula | C16H22F3NO |
|---|---|
| Molecular Weight | 301.17 g/mol |
| LogP | 5.2 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 301.16534 |
| Heavy Atoms | 21 |
| Complexity | 303.0 |
Chemical Identifiers
| CAS Number | 53478-57-2 |
|---|---|
| SMILES | CCCC(CCC)CNC(=O)C1=CC=C(C=C1)C(F)(F)F |
| InChIKey | BWSBQOAFXSJXJD-UHFFFAOYSA-N |
Product Overview
N-(2-丙基戊基)-4-(三氟甲基)苯甲酰胺 (CAS 53478-57-2), with molecular formula C16H22F3NO and molecular weight 301.17 g/mol. IUPAC: N-(2-propylpentyl)-4-(trifluoromethyl)benzamide.
Chemical Property Profile of N-(2-丙基戊基)-4-(三氟甲基)苯甲酰胺
Property Insights of N-(2-丙基戊基)-4-(三氟甲基)苯甲酰胺
The XLogP value of 5.2 indicates that N-(2-丙基戊基)-4-(三氟甲基)苯甲酰胺 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, N-(2-丙基戊基)-4-(三氟甲基)苯甲酰胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2-丙基戊基)-4-(三氟甲基)苯甲酰胺 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-(2-丙基戊基)-4-(三氟甲基)苯甲酰胺?
The CAS number of N-(2-丙基戊基)-4-(三氟甲基)苯甲酰胺 is 53478-57-2.
What is the molecular formula of N-(2-丙基戊基)-4-(三氟甲基)苯甲酰胺?
The molecular formula of N-(2-丙基戊基)-4-(三氟甲基)苯甲酰胺 is C16H22F3NO.
What is the molecular weight of N-(2-丙基戊基)-4-(三氟甲基)苯甲酰胺?
The molecular weight of N-(2-丙基戊基)-4-(三氟甲基)苯甲酰胺 is 301.17 g/mol.
Where can I buy N-(2-丙基戊基)-4-(三氟甲基)苯甲酰胺?
You can request a quote for N-(2-丙基戊基)-4-(三氟甲基)苯甲酰胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-丙基戊基)-4-(三氟甲基)苯甲酰胺?
Yes, KEHONG BIO provides custom synthesis services for N-(2-丙基戊基)-4-(三氟甲基)苯甲酰胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.